Found 8 results

Search term: MF = 'C_{11}H_{11}DO_{2}'
ChemSpider 2D Image | Methyl (1S,2S)-2-phenyl(1-~2~H)cyclopropanecarboxylate | C11H11DO2

Methyl (1S,2S)-2-phenyl(1-2H)cyclopropanecarboxylate

  • Molecular FormulaC11H11DO2
  • Average mass177.218 Da
  • Monoisotopic mass177.090012 Da
  • ChemSpider ID9854629

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1S,2S)-2-Phényl(1-2H)cyclopropanecarboxylate de méthyle [French] [ACD/IUPAC Name]
Cyclopropane-1-d-carboxylic acid, 2-phenyl-, methyl ester, (1S,2S)- [ACD/Index Name]
Methyl (1S,2S)-2-phenyl(1-2H)cyclopropanecarboxylate [ACD/IUPAC Name]
Methyl-(1S,2S)-2-phenyl(1-2H)cyclopropancarboxylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 248.9±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.6±3.0 kJ/mol
Flash Point: 95.8±9.0 °C
Index of Refraction: 1.548
Molar Refractivity: 49.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.05
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.42
ACD/KOC (pH 5.5): 429.03
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.42
ACD/KOC (pH 7.4): 429.03
Polar Surface Area: 26 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 155.0±3.0 cm3

Click to predict properties on the Chemicalize site


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